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Crystal and molecular structure of 5-bromopyridine-2,3-diamine 5-溴-2,3-吡啶二胺的晶体和分子结构
Zeitschrift für Kristallographie - New Crystal Structures Pub Date : 2024-07-26 DOI: 10.1515/ncrs-2024-0221
Irina S. Konovalova, G. Reiss
{"title":"Crystal and molecular structure of 5-bromopyridine-2,3-diamine","authors":"Irina S. Konovalova, G. Reiss","doi":"10.1515/ncrs-2024-0221","DOIUrl":"https://doi.org/10.1515/ncrs-2024-0221","url":null,"abstract":"\u0000 C5H6BrN3, orthorhombic, P212121 (no. 19), a = 3.82640(10) Å, b = 8.7336(2) Å, c = 18.6007(3) Å, V = 621.60(2) Å3, Z = 4, R\u0000 gt(F) = 0.0184, wR\u0000 ref = 0.0473, T = 100(2) K.","PeriodicalId":23885,"journal":{"name":"Zeitschrift für Kristallographie - New Crystal Structures","volume":"31 12","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-07-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141800669","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Hydrogen bonding and π⋅⋅⋅halogen interactions in the crystal structure of bis(theophyllinium) hexachloridoplatinate(IV) monohydrate 一水双(茶碱)六氯铂(IV)晶体结构中的氢键和π⋅⋅卤素相互作用
Zeitschrift für Kristallographie - New Crystal Structures Pub Date : 2024-07-26 DOI: 10.1515/ncrs-2024-0206
G. Reiss, Maik Wyshusek, Jana C. Rheinländer, Irina S. Konovalova
{"title":"Hydrogen bonding and π⋅⋅⋅halogen interactions in the crystal structure of bis(theophyllinium) hexachloridoplatinate(IV) monohydrate","authors":"G. Reiss, Maik Wyshusek, Jana C. Rheinländer, Irina S. Konovalova","doi":"10.1515/ncrs-2024-0206","DOIUrl":"https://doi.org/10.1515/ncrs-2024-0206","url":null,"abstract":"\u0000 C14H20Cl6N8O5Pt, monoclinic, P21/n (no. 14), a = 13.4907(2) Å, b = 13.32240(10) Å, c = 13.8035(2) Å, β = 102.241(1)∘, Z = 4, V = 2424.48(5) Å3, R\u0000 gt(F) = 0.0256, wR\u0000 ref(F\u0000 2) = 0.0740, T = 290 K.","PeriodicalId":23885,"journal":{"name":"Zeitschrift für Kristallographie - New Crystal Structures","volume":"38 30","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-07-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141800281","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
The crystal structure of 1,3-bis(2,4-dinitro-1H-imidazol-1-yl)propane 1,3-双(2,4-二硝基-1H-咪唑-1-基)丙烷的晶体结构
Zeitschrift für Kristallographie - New Crystal Structures Pub Date : 2024-07-26 DOI: 10.1515/ncrs-2024-0247
Chen Cong, Liu Lulu, Zhang Jihui, Jinfeng He, Lizhen Chen, Jianlong Wang
{"title":"The crystal structure of 1,3-bis(2,4-dinitro-1H-imidazol-1-yl)propane","authors":"Chen Cong, Liu Lulu, Zhang Jihui, Jinfeng He, Lizhen Chen, Jianlong Wang","doi":"10.1515/ncrs-2024-0247","DOIUrl":"https://doi.org/10.1515/ncrs-2024-0247","url":null,"abstract":"\u0000 C9H8N8O8, monoclinic, P21/c (no. 14), a = 12.0387(3) Å, b = 10.7899(2) Å, c = 11.4310(3) Å, β = 111.536(3)°, V = 1,381.18(6) Å3, Z = 4, R\u0000 \u0000 gt\u0000 (F) = 0.0499, wR\u0000 \u0000 ref\u0000 (F\u0000 2) = 0.1396, T = 293 K.","PeriodicalId":23885,"journal":{"name":"Zeitschrift für Kristallographie - New Crystal Structures","volume":"19 1","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-07-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141800902","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
The crystal structure of pyrrolidin-1-yl pivalate, C9H13NO4 特戊酸吡咯烷-1-基酯（C9H13NO4）的晶体结构
Zeitschrift für Kristallographie - New Crystal Structures Pub Date : 2024-07-26 DOI: 10.1515/ncrs-2024-0226
Ivan P. Bogdanov, H. Stammler, Nikolay T. Tzvetkov
{"title":"The crystal structure of pyrrolidin-1-yl pivalate, C9H13NO4","authors":"Ivan P. Bogdanov, H. Stammler, Nikolay T. Tzvetkov","doi":"10.1515/ncrs-2024-0226","DOIUrl":"https://doi.org/10.1515/ncrs-2024-0226","url":null,"abstract":"\u0000 C9H13NO4, orthorhombic, P212121 (no. 19), a = 5.8406(1) Å, b = 7.0840(1) Å, c = 24.3697(3) Å, V = 1,008.29(3) Å3, Z = 4, Rgt\u0000 (F) = 0.0148, wRref\u0000 (F\u0000 2) = 0.0381, T = 100.0(1) K.","PeriodicalId":23885,"journal":{"name":"Zeitschrift für Kristallographie - New Crystal Structures","volume":"25 8","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-07-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141801969","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Retraction of: Crystal structure of bis[diaquaisonicotinatosamarium(III)]-µ-isonicotinato-[diisonicotinatocopper(II)], CuSm2(C6H4NO2)8(H2O)4 撤回：双[二异烟酸砷钐(III)]-µ-异烟酸砷-[二异烟酸铜(II)]，CuSm2(C6H4NO2)8(H2O)4 的晶体结构
Zeitschrift für Kristallographie - New Crystal Structures Pub Date : 2024-07-26 DOI: 10.1515/ncrs-2024-0268
Yi-fang Deng, Xue Nie, Chun-Hua Zhang, D. Kuang
{"title":"Retraction of: Crystal structure of bis[diaquaisonicotinatosamarium(III)]-µ-isonicotinato-[diisonicotinatocopper(II)], CuSm2(C6H4NO2)8(H2O)4","authors":"Yi-fang Deng, Xue Nie, Chun-Hua Zhang, D. Kuang","doi":"10.1515/ncrs-2024-0268","DOIUrl":"https://doi.org/10.1515/ncrs-2024-0268","url":null,"abstract":"","PeriodicalId":23885,"journal":{"name":"Zeitschrift für Kristallographie - New Crystal Structures","volume":"56 48","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-07-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141799440","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Synthesis and crystal structure of (Z)-4-((1-(3-fluorophenyl)-1H-1,2,3-triazol-4-yl)methylene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one, C19H14FN5O (Z)-4-((1-(3-氟苯基)-1H-1,2,3-三唑-4-基)亚甲基)-5-甲基-2-苯基-2,4-二氢-3H-吡唑-3-酮，C19H14FN5O 的合成及晶体结构
Zeitschrift für Kristallographie - New Crystal Structures Pub Date : 2024-07-25 DOI: 10.1515/ncrs-2024-0213
I. Konovalova, Anna O. Geleverya, Anton P. Semenets, Sergiy M. Kovalenko, G. Reiss
{"title":"Synthesis and crystal structure of (Z)-4-((1-(3-fluorophenyl)-1H-1,2,3-triazol-4-yl)methylene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one, C19H14FN5O","authors":"I. Konovalova, Anna O. Geleverya, Anton P. Semenets, Sergiy M. Kovalenko, G. Reiss","doi":"10.1515/ncrs-2024-0213","DOIUrl":"https://doi.org/10.1515/ncrs-2024-0213","url":null,"abstract":"\u0000 C19H14FN5O, monoclinic, P21/c (no. 14), a = 7.2944(3) Å, b = 12.2032(5) Å, c = 18.1070(7) Å, β = 95.807(4)°, V = 1603.52(11) Å3, Z = 4, R\u0000 gt(F) = 0.0451, wR\u0000 ref = 0.1217, T = 100(2) K.","PeriodicalId":23885,"journal":{"name":"Zeitschrift für Kristallographie - New Crystal Structures","volume":"30 14","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-07-25","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141806373","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
The crystal structure of the coordination compound catena-poly[(18-crown-6-ether-κ 6 O 6)(4,5-dinitroimidazolato-κ 1 O)potassium(I)] 配位化合物 catena-poly[(18-crown-6-ether-κ 6 O 6)(4,5-二硝基咪唑-κ 1 O)钾(I)]的晶体结构
Zeitschrift für Kristallographie - New Crystal Structures Pub Date : 2024-07-25 DOI: 10.1515/ncrs-2024-0216
Song Le, Liu Lulu, Jinfeng He, He Dan
{"title":"The crystal structure of the coordination compound catena-poly[(18-crown-6-ether-κ\u0000 6\u0000 O\u0000 6)(4,5-dinitroimidazolato-κ\u0000 1\u0000 O)potassium(I)]","authors":"Song Le, Liu Lulu, Jinfeng He, He Dan","doi":"10.1515/ncrs-2024-0216","DOIUrl":"https://doi.org/10.1515/ncrs-2024-0216","url":null,"abstract":"\u0000 C15H25KN4O10, monoclinic, P21 (no. 4), a = 8.3669(3) Å, b = 13.6610(4) Å, c = 9.6179(3) Å, β = 104.578(1)°, V = 1063.94(6) Å3, Z = 2, Rgt\u0000 (F) = 0.0391, wRref\u0000 (F\u0000 2) = 0.0863, T = 150 K.","PeriodicalId":23885,"journal":{"name":"Zeitschrift für Kristallographie - New Crystal Structures","volume":"12 3","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-07-25","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141803268","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Crystal structure of (S)-1-phenylpropan-1-aminium (S)-(1-phenylpropyl)carbamate C19H26N2O2 (S)-(1-苯基丙基)氨基甲酸酯 C19H26N2O2 的晶体结构
Zeitschrift für Kristallographie - New Crystal Structures Pub Date : 2024-07-24 DOI: 10.1515/ncrs-2024-0252
Qiong-Feng Jiang, Guangchuan Ou
{"title":"Crystal structure of (S)-1-phenylpropan-1-aminium (S)-(1-phenylpropyl)carbamate C19H26N2O2","authors":"Qiong-Feng Jiang, Guangchuan Ou","doi":"10.1515/ncrs-2024-0252","DOIUrl":"https://doi.org/10.1515/ncrs-2024-0252","url":null,"abstract":"\u0000 <jats:p>C<jats:sub>19</jats:sub>H<jats:sub>26</jats:sub>N<jats:sub>2</jats:sub>O<jats:sub>2</jats:sub>, orthorhombic, <jats:italic>P</jats:italic>2<jats:sub>1</jats:sub>2<jats:sub>1</jats:sub>2<jats:sub>1</jats:sub> (no. 19), <jats:italic>a</jats:italic> = 5.254(2) Å, <jats:italic>b</jats:italic> = 12.172(6) Å, <jats:italic>c</jats:italic> = 29.088(13) Å, <jats:italic>V</jats:italic> = 1860.2(14) Å<jats:sup>3</jats:sup>, <jats:italic>Z</jats:italic> = 4, <jats:italic>R</jats:italic>\u0000 <jats:sub>\u0000 <jats:italic>gt</jats:italic>\u0000 </jats:sub>(<jats:italic>F</jats:italic>) = 0.0509, <jats:italic>wR</jats:italic>\u0000 <jats:sub>\u0000 <jats:italic>ref</jats:italic>\u0000 </jats:sub>(<jats:italic>F</jats:italic>\u0000 <jats:sup>2</jats:sup>) = 0.1345, T = 173 K.</jats:p>","PeriodicalId":23885,"journal":{"name":"Zeitschrift für Kristallographie - New Crystal Structures","volume":"6 5","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-07-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141807647","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Crystal structure of 7-(diethylamino)-3-(trifluoroacetyl)-2H-chromen-2-one, C15H14F3NO3 7-(二乙基氨基)-3-(三氟乙酰基)-2H-苯并吡喃-2-酮（C15H14F3NO3）的晶体结构
Zeitschrift für Kristallographie - New Crystal Structures Pub Date : 2024-07-24 DOI: 10.1515/ncrs-2024-0217
Huanxin Wang, Yingfan Liu
{"title":"Crystal structure of 7-(diethylamino)-3-(trifluoroacetyl)-2H-chromen-2-one, C15H14F3NO3","authors":"Huanxin Wang, Yingfan Liu","doi":"10.1515/ncrs-2024-0217","DOIUrl":"https://doi.org/10.1515/ncrs-2024-0217","url":null,"abstract":"\u0000 C15H14F3NO3, monoclinic, P21 (no. 4), a = 5.0637(5) Å, b = 19.1061(19) Å, c = 7.4883(6) Å, β = 95.666(9)°, V = 720.94(12) Å3, Z = 2, Rgt\u0000 (F) = 0.0463, wRref\u0000 (F\u0000 2) = 0.1036, T = 294.8(6) K.","PeriodicalId":23885,"journal":{"name":"Zeitschrift für Kristallographie - New Crystal Structures","volume":"73 6","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-07-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141807880","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Crystal stucture of 3-benzamido-N-(2-bromo-4-(perfluoropropan-2-yl)-6-(trifluoromethyl)phenyl)-2-fluorobenzamide 3-苯甲酰胺基-N-(2-溴-4-(全氟丙-2-基)-6-(三氟甲基)苯基)-2-氟苯甲酰胺的晶体结构
Zeitschrift für Kristallographie - New Crystal Structures Pub Date : 2024-07-23 DOI: 10.1515/ncrs-2024-0174
Haiyan Zhang, Kai Fu
{"title":"Crystal stucture of 3-benzamido-N-(2-bromo-4-(perfluoropropan-2-yl)-6-(trifluoromethyl)phenyl)-2-fluorobenzamide","authors":"Haiyan Zhang, Kai Fu","doi":"10.1515/ncrs-2024-0174","DOIUrl":"https://doi.org/10.1515/ncrs-2024-0174","url":null,"abstract":"\u0000 C24H12BrF11N2O2, M = 648.26 g/mol, triclinic, P1̄ (no. 2), a = 8.9871(10) Å, b = 9.6519(10) Å, c = 13.8769(13) Å, α = 88.141(3)°, β = 83.049(3)°, γ = 87.821(4)°, V = 1193.5(2) Å3, Z = 2, R\u0000 \u0000 gt\u0000 (F) = 0.0604, wR\u0000 \u0000 ref\u0000 (F\u0000 2) = 0.1624, T = 170 K.","PeriodicalId":23885,"journal":{"name":"Zeitschrift für Kristallographie - New Crystal Structures","volume":"118 43","pages":""},"PeriodicalIF":0.0,"publicationDate":"2024-07-23","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141811883","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
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